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MolNFT v1 · #67582 · protein

Crystal structure of glucagon-like peptide-1 in complex with the extracellular domain of the glucagon-like peptide-1 receptor

3IOL · Glucagon-like peptide 1 receptor: “Crystal structure of glucagon-like peptide-1 in complex with the extracellular domain of the glucagon-like…”. X-ray diffraction, 1 ligand (10M), 1 pocket (best druggability 0.29). MolNFT v1 #67582…

PDB
3IOL
Type
protein
Length
126 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glucagon-like peptide 1 receptor; Glucagon
UniProt
P43220, P01275
Ligands
10M
Pockets
1 · best druggability 0.29

Structure

x-ray diffraction · 2 distinct chains · 38% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGlucagon-like peptide 1 receptorprotein10027% helix, 22% strandP43220
BGlucagonprotein2681% helix, 0% strandP01275

Ligands and binding sites

  • 10M · decyl 4-O-alpha-D-glucopyranosyl-1-thio-beta-D-glucopyranoside · ligand · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1610.290.7412empty

Interfaces

1 interface between chains.

  • A–B · 565 Ų buried · 4 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 3 disulfide (disulfide).

Compared structures

  • 3IOL · Crystal structure of Glucagon-Like Peptide-1 in complex with the extracellular domain of… · the same entry in another collection · chain A against A, TM-score 1.00
  • P43220 · AlphaFold monomer V2.0 prediction for glucagon-like peptide 1 receptor (P43220) · a predicted model of the same protein · chain A against A, TM-score 0.98
  • P01275 · AlphaFold monomer V2.0 prediction for pro-glucagon (P01275) · a predicted model of the same protein · chain B against A, TM-score 0.57

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